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1,2,6-Nonadecanetriol, 5-ethenyl-4-methyl-3-(phenylmethoxy)-, [2R-(2R*,3S*,4S*,5S*,6S*)]-
SpectraBase Compound ID L4bnA7uGM2e
InChI InChI=1S/C29H50O4/c1-4-6-7-8-9-10-11-12-13-14-18-21-27(31)26(5-2)24(3)29(28(32)22-30)33-23-25-19-16-15-17-20-25/h5,15-17,19-20,24,26-32H,2,4,6-14,18,21-23H2,1,3H3/t24-,26-,27-,28+,29-/m0/s1
InChIKey JUKSYANRPPHWIL-WJCXGNHWSA-N
Mol Weight 462.7 g/mol
Molecular Formula C29H50O4
Exact Mass 462.37091 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DOzd685aTrM
Name 1,2,6-Nonadecanetriol, 5-ethenyl-4-methyl-3-(phenylmethoxy)-, [2R-(2R*,3S*,4S*,5S*,6S*)]-
CAS Registry Number 133604-23-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H50O4
InChI InChI=1S/C29H50O4/c1-4-6-7-8-9-10-11-12-13-14-18-21-27(31)26(5-2)24(3)29(28(32)22-30)33-23-25-19-16-15-17-20-25/h5,15-17,19-20,24,26-32H,2,4,6-14,18,21-23H2,1,3H3/t24-,26-,27-,28+,29-/m0/s1
InChIKey JUKSYANRPPHWIL-WJCXGNHWSA-N
Molecular Weight 462.715 g/mol
SMILES O[C@](CO)([C@]([C@]([C@](C=C)([C@@](O)(CCCCCCCCCCCCC)[H])[H])(C)[H])(OCc1ccccc1)[H])[H]
SPLASH splash10-0udl-8014900000-f84d0f35158c51cc51c3
Source of Spectrum C-113-4228-70
Synonyms (2R,3S,4S,5S,6S)-3-O-benzyl-4-methyl-5-vinylnonadecane-1,2,3,6-tetrol 3-O-benzyl-1,2-dideoxy-2-{(1S)-1-[(1S)-1-hydroxytetradecyl]-2-propenyl}-D-arabinitol
Wiley ID 1391182